3-{[(4-fluorophenyl)methyl]sulfanyl}-5-(2-phenylethyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-{[(4-fluorophenyl)methyl]sulfanyl}-5-(2-phenylethyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazole
3-{[(4-fluorophenyl)methyl]sulfanyl}-5-(2-phenylethyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | Y205-2493 |
| Compound Name: | 3-{[(4-fluorophenyl)methyl]sulfanyl}-5-(2-phenylethyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazole |
| Molecular Weight: | 353.46 |
| Molecular Formula: | C20 H20 F N3 S |
| Smiles: | C=CCn1c(CCc2ccccc2)nnc1SCc1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 4.5416 |
| logD: | 4.5416 |
| logSw: | -4.5901 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 25.1953 |
| InChI Key: | UESPIYXGZAOEGH-UHFFFAOYSA-N |